IBS-ZINC01786955 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.5730 1.8650 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.5370 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.9030 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 0.5970 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 0.9240 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 1.5590 1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -0.0930 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -0.6030 -1.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 -0.0780 0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 -0.8220 0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9640 -1.7670 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -1.1040 1.3700 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0520 -1.5270 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -2.1570 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -1.7780 3.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 0.1030 2.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2060 0.0450 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0160 -0.8580 3.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 1.2560 3.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1840 1.4120 4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 2.5370 5.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 3.5110 5.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2060 3.3610 4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 2.2350 3.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1530 -0.0630 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 1.1440 -1.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 -0.9090 -1.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 -0.5630 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8330 -1.5990 -3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8150 -1.3450 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9990 -0.0480 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2100 0.9920 -3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2270 0.7330 -2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2070 0.2710 -5.6260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 2.3540 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.7710 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 0.6470 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 0.6780 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 1.8070 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9580 0.6560 5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9780 2.6500 6.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2190 4.3850 6.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 4.1190 4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3910 2.1340 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 -1.8920 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7060 -2.6200 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4270 -2.1620 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3480 2.0070 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6320 1.5700 -2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2650 -3.3020 1.5990 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 50 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 48 1 0 0 0 0 33 49 1 0 0 0 0 M CHG 1 50 -1 M END